SCHEMBL2398090

SCHEMBL2398090

Cc1c(F)cc(C(=O)NC2CC2)cc1-c1ccc2c(=O)n(CC(C)(C)CO)cc(S(=O)(=O)NCCN(C)C)c2c1

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 9/20 0.46
CYP2C9 P11712 4/20 0.46
MAPK13 O15264 11/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12310253 0.86 MAPK14 (0.49) MAPK14CYP2C9MAPK13
SCHEMBL2398076 0.84 MAPK14 (0.47) MAPK14CYP2C9MAPK13
SCHEMBL2390837 0.83 MAPK14 (0.46) MAPK14CYP2C9MAPK13
SCHEMBL1725524 0.83 MAPK14 (0.46) MAPK14CYP2C9MAPK13
SCHEMBL1722735 0.82 MAPK14 (0.51) MAPK14CYP2C9MAPK13
SCHEMBL2390696 0.82 MAPK14 (0.45) MAPK14CYP2C9MAPK13
SCHEMBL2394658 0.82 MAPK14 (0.45) MAPK14CYP2C9MAPK13
SCHEMBL1728728 0.81 MAPK14 (0.44) MAPK14CYP2C9MAPK13
SCHEMBL2390786 0.80 MAPK14 (0.43) MAPK14CYP2C9MAPK13
SCHEMBL2390789 0.79 MAPK14 (0.42) MAPK14CYP2C9MAPK13

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8012980-B2 Isoquinolinone derivatives ASTRAZENECA AB (SE) 2011-09-06 US disclosed
US-8012980-B2 Isoquinolinone derivatives ASTRAZENECA AB (SE) 2011-09-06 US disclosed
US-8012980-B2 Isoquinolinone derivatives ASTRAZENECA AB (SE) 2011-09-06 US disclosed
US-20100099665-A1 ISOQUINOLINONE DERIVATIVES ASTRAZENECA AB (SE) 2010-04-22 US disclosed
US-20100099665-A1 ISOQUINOLINONE DERIVATIVES ASTRAZENECA AB (SE) 2010-04-22 US disclosed
US-20100099665-A1 ISOQUINOLINONE DERIVATIVES ASTRAZENECA AB (SE) 2010-04-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100099665-A1 ISOQUINOLINONE DERIVATIVES SDHA, NQO1, CYP3A5 MAPK14 3792/4885CYP2C9 98/4885MAPK13 4717/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.